SCHEMBL9847255

SCHEMBL9847255

CCCCC(CCCC)Nc1ccc(/C=C/c2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 6/20 0.49
MAPT P10636 6/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
LMNA P02545 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
ALDH1A1 P00352 4/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HTT P42858 1/20 0.44
APP P05067 1/20 0.44
FBP1 P09467 1/20 0.43
PTGS1 P23219 2/20 0.43
GAA P10253 1/20 0.43
CYP19A1 P11511 2/20 0.42
RECQL P46063 2/20 0.41
APEX1 P27695 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CA12 O43570 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9847310 0.96 PTGS2 (0.46) PTGS2MAPTNPC1RAB9ALMNA
SCHEMBL9847264 0.95 PTGS2 (0.47) PTGS2MAPTNPC1RAB9ALMNA
SCHEMBL9847271 0.88 PTGS2 (0.48) PTGS2MAPTNPC1RAB9ALMNA
SCHEMBL21941003 0.86 MAPT (0.50) MAPTLMNAMEN1KMT2ANPSR1
SCHEMBL9847340 0.79 ALDH1A1 (0.53) PTGS2MAPTNPC1RAB9ALMNA
SCHEMBL9358456 0.77 MAPT (0.46) MAPTNPC1RAB9ALMNAMEN1
SCHEMBL9358461 0.77 MAPT (0.46) MAPTNPC1RAB9ALMNAMEN1
SCHEMBL9839382 0.77 MAPT (0.54) PTGS2MAPTNPC1RAB9ALMNA
SCHEMBL590835 0.77 MAPT (0.54) PTGS2MAPTNPC1RAB9ALMNA
SCHEMBL590836 0.77 MAPT (0.54) PTGS2MAPTNPC1RAB9ALMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0406888-A2 Nonlinear optical polymer composition and method for producing the same SUMITOMO ELECTRIC INDUSTRIES, LTD. (JP) 1991-01-09 EP disclosed